| SpectraBase Spectrum ID |
5ehITI5XOye |
| Name |
2-Butenoic acid, 4-hydroxy-2-methyl-, 2,3,3A,4,5,8,9,11A-octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-2-oxocyclodeca[B]furan-4-yl ester, [3ar-[3ar*,4S*(Z),6E,10Z,11AR*]], 2tms |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
506.251992136 u |
| Formula |
C26H42O6Si2 |
| InChI |
InChI=1S/C26H42O6Si2/c1-18-11-10-12-21(17-30-34(7,8)9)16-23-24(20(3)26(28)32-23)22(15-18)31-25(27)19(2)13-14-29-33(4,5)6/h11,13,16,22-24H,3,10,12,14-15,17H2,1-2,4-9H3/b18-11+,19-13-,21-16-/t22-,23+,24+/m0/s1 |
| InChIKey |
HLZBLUFSFRJHAW-YKICEYLRSA-N |
| Molecular Weight |
506.786 g/mol |
| SMILES |
C1C\C(=C\[C@@]2([C@@]([C@](C\C(=C\1)C)(OC(\C(=C/CO[Si](C)(C)C)C)=O)[H])(C(=C)C(O2)=O)[H])[H])CO[Si](C)(C)C |
![2-Butenoic acid, 4-hydroxy-2-methyl-, 2,3,3A,4,5,8,9,11A-octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-2-oxocyclodeca[B]furan-4-yl ester, [3ar-[3ar*,4S*(Z),6E,10Z,11AR*]], 2tms](/api/spectrum/5ehITI5XOye/structure.png?h=300&w=458 "2-Butenoic acid, 4-hydroxy-2-methyl-, 2,3,3A,4,5,8,9,11A-octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-2-oxocyclodeca[B]furan-4-yl ester, [3ar-[3ar*,4S*(Z),6E,10Z,11AR*]], 2tms")
